(R)-N-(1-(3-(3-chloro-4-cyano-2-methylphenyl)-1H-pyrazol-1-yl)butan-2-yl)oxazole-4-carboxamide
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Basic information
- Standard SMILES
CC[C@H](Cn1ccc(-c2ccc(C#N)c(Cl)c2C)n1)NC(=O)c1cocn1- InChIKey
CJRLCATVQJNELW-CQSZACIVSA-N- Molecular formula
- C19H18ClN5O2
- Average molar mass
- 383.8 g/mol
- Monoisotopic mass
- 383.1149025
Names & identifiers
- Preferred name
- (R)-N-(1-(3-(3-chloro-4-cyano-2-methylphenyl)-1H-pyrazol-1-yl)butan-2-yl)oxazole-4-carboxamide
- IUPAC
- N-[(2R)-1-[3-(3-chloro-4-cyano-2-methylphenyl)pyrazol-1-yl]butan-2-yl]-1,3-oxazole-4-carboxamide
Names & synonyms
SCHEMBL12079998CJRLCATVQJNELW-CQSZACIVSA-N(R)-N-(1-(3-(3-chloro-4-cyano-2-methylphenyl)-1H-pyrazol-1-yl)butan-2-yl)oxazole-4-carboxamide
Database identifiers
- PubChem CID
- 70656282
Properties
Computed structural propertiesFilling in
- XLogP
- 3.2
- Topological polar surface area
- 96.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 568
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Related reactions
1 records
Compound notes
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